AI61939
926201-08-3 | 4-Bromo-1-fluoro-2-(cyclopropanaminomethyl)benzene
Manufacturer: A2B Chem
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CatalogNumber
AI61939
ChemicalName
4-Bromo-1-fluoro-2-(cyclopropanaminomethyl)benzene
CasNumber
926201-08-3
MolecularFormula
C10H11BrFN
MolecularWeight
244.1034
MdlNumber
MFCD09047386
Smiles
Fc1ccc(cc1CNC1CC1)Br
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.6
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CatalogNumber: AI61939
ChemicalName: 4-Bromo-1-fluoro-2-(cyclopropanaminomethyl)benzene
CasNumber: 926201-08-3
MolecularFormula: C10H11BrFN
MolecularWeight: 244.1034
MdlNumber: MFCD09047386
Smiles: Fc1ccc(cc1CNC1CC1)Br
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.6
CatalogNumber:
AI61939
ChemicalName:
4-Bromo-1-fluoro-2-(cyclopropanaminomethyl)benzene
CasNumber:
926201-08-3
MolecularFormula:
C10H11BrFN
MolecularWeight:
244.1034
MdlNumber:
MFCD09047386
Smiles:
Fc1ccc(cc1CNC1CC1)Br
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cc(ccc1Cl)c1ccc(cc1)C(C)(C)C
Complexity: 339
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cc(ccc1Cl)c1ccc(cc1)C(C)(C)C
Complexity:
339
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1ccc(c(c1)Cl)C(=O)N1CCOCC1
Complexity: 256
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1ccc(c(c1)Cl)C(=O)N1CCOCC1
Complexity:
256
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1cccc(c1)c1ccc(c(c1)Cl)Cl
Complexity: 210
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1cccc(c1)c1ccc(c(c1)Cl)Cl
Complexity:
210
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.6